Home Halogens Oxazole, 4-(chloromethyl)-2-(1,1-dimethylethyl)-

Oxazole, 4-(chloromethyl)-2-(1,1-dimethylethyl)-

CAS No.:
198075-82-0
Catalog Number:
AG002B9A
Molecular Formula:
C8H12ClNO
Molecular Weight:
173.6400
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Product Description
Catalog Number:
AG002B9A
Chemical Name:
Oxazole, 4-(chloromethyl)-2-(1,1-dimethylethyl)-
CAS Number:
198075-82-0
Molecular Formula:
C8H12ClNO
Molecular Weight:
173.6400
MDL Number:
MFCD19347391
IUPAC Name:
2-tert-butyl-4-(chloromethyl)-1,3-oxazole
InChI:
InChI=1S/C8H12ClNO/c1-8(2,3)7-10-6(4-9)5-11-7/h5H,4H2,1-3H3
InChI Key:
JMIGYIRQBGPJLG-UHFFFAOYSA-N
SMILES:
ClCc1coc(n1)C(C)(C)C
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.64g/mol
Monoisotopic Mass:
173.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties